28910
1,4-环己二烯
purum, ≥97.0% (GC)
别名:
1,4-二氢苯
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关于此项目
经验公式（希尔记法）:
C6H8
化学文摘社编号:
分子量:
80.13
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
211-043-1
Beilstein/REAXYS Number:
1900733
MDL number:
Assay:
≥97.0% (GC)
Form:
liquid
InChI key
UVJHQYIOXKWHFD-UHFFFAOYSA-N
InChI
1S/C6H8/c1-2-4-6-5-3-1/h1-2,5-6H,3-4H2
SMILES string
C1C=CCC=C1
grade
purum
assay
≥97.0% (GC)
form
liquid
contains
~0.2% 2,6-di-tert-butyl-4-methylphenol as stabilizer
Quality Level
refractive index
n20/D 1.473
bp
88-89 °C (lit.)
density
0.847 g/mL at 25 °C (lit.)
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General description
1,4-Cyclohexadiene is an effective hydrogen donor for catalytic hydrogenation reaction. The interaction between graphene segments and 1,4-cyclohexadiene was stuided using density-functional tight-binding (DFTB) method.
Application
1,4-Cyclohexadiene (1,4-CHD) was used to study the formation of parent ion from heavy fragmentation of 1,4-CHD on irradiation with a high-intensity laser pulse.
Other Notes
通过催化氢转移反应，在苄醚存在下选择性裂解苄酯
signalword
Danger
hcodes
Hazard Classifications
Carc. 1A - Flam. Liq. 2 - Muta. 1B - STOT RE 2
target_organs
Blood
存储类别
3 - Flammable liquids
wgk
WGK 3
flash_point_f
19.4 °F - closed cup
flash_point_c
-7 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
A.M. Felix et al.
The Journal of Organic Chemistry, 43, 4194-4194 (1978)
J.S. Bajwa
Tetrahedron Letters, 33, 2299-2299 (1992)
William A Donald et al.
Dalton transactions (Cambridge, England : 2003), 41(11), 3185-3193 (2012-01-31)
Relatively little is known about structural transformations of very small metal clusters that result from the adsorption of molecules. Here, the ligand-induced structural transformation of Ag(5)(+)(g) by 1,4-cyclohexadiene, which is capable of binding metal clusters as a bidentate ligand, is
Vladimir S Petrović et al.
Physical review letters, 108(25), 253006-253006 (2012-09-26)
We report the first study of UV-induced photoisomerization probed via core ionization by an x-ray laser. We investigated x-ray ionization and fragmentation of the cyclohexadiene-hexatriene system at 850 eV during the ring opening. We find that the ion-fragmentation patterns evolve
Monika Ali Khan et al.
Chemical communications (Cambridge, England), 47(1), 215-217 (2010-08-24)
A cyclohexadiene ligand prepared by microbial arene 1,2-dihydroxylation undergoes spontaneous rearrangement upon complexation to tricarbonyliron(0). Subsequent iron removal affords a novel route to formal arene 2,3-dihydroxylation products enantiomeric to those obtainable by direct microbial arene oxidation.
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